2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide

C20H23N3O3 — CID 90521344

IUPAC2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide
SMILESO=C(COc1ccccc1)NCC1CCN(C(=O)c2cccnc2)CC1
InChIInChI=1S/C20H23N3O3/c24-19(15-26-18-6-2-1-3-7-18)22-13-16-8-11-23(12-9-16)20(25)17-5-4-10-21-14-17/h1-7,10,14,16H,8-9,11-13,15H2,(H,22,24)
InChIKeyQQOSJUVYFSDDSL-UHFFFAOYSA-N
MW353.42 g/mol
LogP2.13
Rot. Bonds6

About 2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide

2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide (PubChem CID 90521344) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound Name2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide
PubChem CID90521344
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide
SMILESO=C(COc1ccccc1)NCC1CCN(C(=O)c2cccnc2)CC1
InChIInChI=1S/C20H23N3O3/c24-19(15-26-18-6-2-1-3-7-18)22-13-16-8-11-23(12-9-16)20(25)17-5-4-10-21-14-17/h1-7,10,14,16H,8-9,11-13,15H2,(H,22,24)
InChIKeyQQOSJUVYFSDDSL-UHFFFAOYSA-N
XLogP2.13
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]propanamide
CID 108924693
2-(2-ethylphenoxy)-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide
CID 108924733
2-benzylsulfanyl-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide
CID 71786523
2-(4-phenylphenyl)-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide
CID 90521437
3-methyl-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]butanamide
CID 90521307
3-methoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]propanamide
CID 108924717
3-cyclopentyl-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]propanamide
CID 90521330
3-(4-fluorophenyl)-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]propanamide
CID 108924798
1-ethyl-3-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]urea
CID 90521465
N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide
CID 90521312
N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]-2-thiophen-2-ylacetamide
CID 90521329
N'-cycloheptyl-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]oxamide
CID 90520980

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide?
The IUPAC name of 2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide (CID 90521344) is 2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for 2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide?
The canonical SMILES for 2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide is O=C(COc1ccccc1)NCC1CCN(C(=O)c2cccnc2)CC1.
What is the InChIKey of 2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide?
The InChIKey is QQOSJUVYFSDDSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c24-19(15-26-18-6-2-1-3-7-18)22-13-16-8-11-23(12-9-16)20(25)17-5-4-10-21-14-17/h1-7,10,14,16H,8-9,11-13,15H2,(H,22,24).
What are the key properties of 2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide?
2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide has a molecular weight of 353.42 g/mol, XLogP of 2.13, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 90521344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).